hydroxy-oxo-phenylphosphanium;zinc

C6H6O2PZn+ — CID 66795245

IUPAChydroxy-oxo-phenylphosphanium;zinc
SMILESO=[P+](O)c1ccccc1.[Zn]
InChIInChI=1S/C6H5O2P.Zn/c7-9(8)6-4-2-1-3-5-6;/h1-5H;/p+1
InChIKeyUJTBCCGPEUOVJJ-UHFFFAOYSA-O
MW206.48 g/mol
LogP1.04
Rot. Bonds1

About hydroxy-oxo-phenylphosphanium;zinc

hydroxy-oxo-phenylphosphanium;zinc (PubChem CID 66795245) has the molecular formula C6H6O2PZn+ and a molecular weight of 206.48 g/mol. Its IUPAC name is hydroxy-oxo-phenylphosphanium;zinc.

Molecular Properties

Compound Namehydroxy-oxo-phenylphosphanium;zinc
PubChem CID66795245
Molecular FormulaC6H6O2PZn+
Molecular Weight206.48 g/mol
Exact Mass204.94
IUPAC Namehydroxy-oxo-phenylphosphanium;zinc
SMILESO=[P+](O)c1ccccc1.[Zn]
InChIInChI=1S/C6H5O2P.Zn/c7-9(8)6-4-2-1-3-5-6;/h1-5H;/p+1
InChIKeyUJTBCCGPEUOVJJ-UHFFFAOYSA-O
XLogP1.04
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.48
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydroxy-oxo-phenylphosphanium;zinc?
The IUPAC name of hydroxy-oxo-phenylphosphanium;zinc (CID 66795245) is hydroxy-oxo-phenylphosphanium;zinc.
What is the SMILES notation for hydroxy-oxo-phenylphosphanium;zinc?
The canonical SMILES for hydroxy-oxo-phenylphosphanium;zinc is O=[P+](O)c1ccccc1.[Zn].
What is the InChIKey of hydroxy-oxo-phenylphosphanium;zinc?
The InChIKey is UJTBCCGPEUOVJJ-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H5O2P.Zn/c7-9(8)6-4-2-1-3-5-6;/h1-5H;/p+1.
What are the key properties of hydroxy-oxo-phenylphosphanium;zinc?
hydroxy-oxo-phenylphosphanium;zinc has a molecular weight of 206.48 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-oxo-phenylphosphanium;zinc is sourced from PubChem (CID 66795245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).